* LIGAND DATABASE FILE (OPLS2005)
*
001      67    70    134    226     404
    1     0 S   NP   _N1_     1    28.86578    94.72035   -24.69310
    2     1 S   H    _HN1     2     1.02788   113.88868   -93.91678
    3     1 S   H    _H1_     3     1.02948    81.06416    12.28501
    4     1 S   H    _H2_     4     1.02828    26.30652  -175.96949
    5     1 S   CT   _CA1     5     1.50112   125.32686   121.03859
    6     5 S   HC   _HA1     6     1.09573   105.19222    84.26536
    7     5 S   CO3  _C1_     7     1.53775   112.41644   -35.98189
    8     7 S   O2Z  _O11     8     1.26373   115.01066   -43.86836
    9     7 S   O2Z  _O12     9     1.26233   114.93421   135.20562
   10     5 S   CT   _CB1    10     1.53069   107.41666  -157.77008
   11    10 S   HC   HB11    11     1.09837   109.36170   -49.68162
   12    10 S   HC   HB12    12     1.09812   110.46467    66.91358
   13    10 S   CT   _CG1    13     1.53010   112.61951  -170.63502
   14    13 S   HC   HG11    14     1.09577   110.68293   -66.06030
   15    13 S   HC   HG12    15     1.09669   109.75218    53.18822
   16    13 S   C    _CD1    16     1.51805   112.09256   173.65746
   17    16 S   O    _OE1    17     1.22751   123.23002     9.38284
   18    16 S   N    _N2_    18     1.38651   111.77686  -170.77244
   19    18 S   H    _HN2    19     1.01591   119.00678     1.23907
   20    18 S   CT1  _CA2    20     1.46195   123.32707   177.01050
   21    20 S   HC   _HA2    21     1.09743   109.29049     4.05772
   22    20 S   C    _C2_    22     1.53611   108.83673  -111.36896
   23    22 S   O    _O2_    23     1.23072   122.22241  -149.48095
   24    20 S   CT   _CB2    32     1.53467   111.71344   125.97066
   25    24 S   HC   HB21    33     1.09522   109.64089    56.71914
   26    24 S   HC   HB22    34     1.09351   109.67581   175.51109
   27    22 S   N    _N3_    24     1.38311   113.79745    38.06805
   28    27 S   H    _HN3    25     1.01569   119.58199    -3.50135
   29    24 S   S    _SG2    35     1.83204   111.11118   -63.94116
   30    27 S   CT   _CA3    26     1.45283   123.25707   177.08301
   31    30 S   HC   HA31    27     1.09548   107.52320   -64.37958
   32    30 S   HC   HA32    28     1.09556   107.97919    52.06905
   33    29 S   CT   _C14    36     1.85712   102.08399  -171.88115
   34    30 S   CO3  _C3_    29     1.52969   114.05088   174.05446
   35    34 S   O2Z  _O31    30     1.26380   116.06322    -0.62087
   36    34 S   O2Z  _O32    31     1.26424   114.41809   179.43977
   37    33 S   CM   _C13    37     1.51442   108.82826    72.86995
   38    37 S   HC   _H17    38     1.08609   119.67058   -57.72105
   39    33 S   CM   _C15    66     1.49068   109.08070   -54.30693
   40    39 S   HC   _H18    67     1.08335   123.79576    78.86273
   41    37 S   CM   _C12    39     1.34541   121.52478   120.56603
   42    41 S   HC   _H16    40     1.08510   120.45681  -178.03457
   43    41 S   CT   _C11    41     1.50749   120.57398     5.08977
   44    43 S   HC   _H5_    42     1.09425   111.68148   161.32629
   45    43 S   CT   _C10    43     1.51939   108.18676    35.97343
   46    45 S   HC   _H14    44     1.09693   113.28275    51.07850
   47    45 S   HC   _H15    45     1.09642   112.35806   171.05829
   48    33 S   CT   _C9_    46     1.56071   113.68367  -161.38046
   49    48 S   CT   _C7_    47     1.54677   115.78730   -44.45838
   50    49 S   HC   _H4_    48     1.09236   113.96033    31.27475
   51    48 S   OS   _O33    63     1.43041   106.44500    84.58442
   52    49 S   CT   _C8_    49     1.53127   115.09343   156.89768
   53    52 S   HC   _H12    50     1.09626   111.04330    50.14302
   54    52 S   HC   _H13    51     1.09656   109.89536   -66.83476
   55    51 S   CMA  _C16    64     1.43035   104.53564    30.47709
   56    55 S   OM   _O34    65     1.26107   123.15924   162.30559
   57    52 S   CT   _C4_    52     1.52806   111.86065   171.96544
   58    57 S   HC   _H6_    53     1.09672   108.74624  -163.76683
   59    57 S   HC   _H7_    54     1.09690   109.81276    80.54864
   60    57 S   CT   _C5_    55     1.52876   113.29695   -41.46545
   61    60 S   HC   _H8_    56     1.09763   109.09153   104.59311
   62    60 S   HC   _H9_    57     1.09595   109.55604  -139.47562
   63    60 S   CT   _C6_    58     1.51810   112.40804   -16.83369
   64    63 S   HC   _H10    59     1.09466   111.34526   178.57412
   65    63 S   HC   _H11    60     1.09554   111.94060   -58.77222
   66    43 S   NP   _N4_    61     1.53328   111.64346   -75.31329
   67    66 S   H    _H3_    62     1.02963   107.66160   -24.26126
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  18   2   1   1  13   5   8   4  11   4  15   8  11   5   4  12
  15   8   4  11   6   5   1   1   9   5   4   7   5   4   4   3
   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    45    48    49    51    55    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    43    45    46    47    48    49    50    52    66    51    55    56    39    40  
   35    36  
   36  
    0  
   38    41    42    43    44    45    48    49    66    51    55    39    40  
   41    42    43    48    39  
   40    41    45    48    49    51    55    56  
   48    51    55    56  
   42    43    44    45    46    47    48    49    63    66    67  
   43    44    45    66  
   44    45    46    47    48    49    50    52    60    63    64    65    66    67    51  
   45    46    47    48    49    63    66    67  
   46    47    48    49    50    52    63    66    67    51    55  
   47    48    49    66    51  
   48    49    66    51  
   49    50    52    53    54    57    63    66    67    51    55    56  
   50    52    53    54    57    58    59    60    63    64    65    66    67    51    55  
   52    53    54    57    63    66    67    51  
   55    56    52    66  
   53    54    57    58    59    60    61    62    63    66    67  
   54    57    58    59    60    66  
   57    58    59    60    66  
   56  
    0  
   58    59    60    61    62    63    64    65    66  
   59    60    61    62    63  
   60    61    62    63  
   61    62    63    64    65    66    67  
   62    63    64    65    66  
   63    64    65    66  
   64    65    66    67  
   65    66    67  
   66    67  
   67  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   3.5000   0.0660   0.424400   1.9750   1.7500   0.005000000  -0.741685710
   49   3.5000   0.0660  -0.014400   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   51   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   55   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   56   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   63   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   67   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    48   268.000  1.529
   33    39   317.000  1.510
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   340.000  1.080
   41    43   317.000  1.510
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    66   367.000  1.471
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   268.000  1.529
   48    51   320.000  1.410
   49    50   340.000  1.090
   49    52   268.000  1.529
   49    66   367.000  1.471
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   367.000  1.471
   66    67   434.000  1.010
   51    55   440.000  1.360
   55    56   745.000  1.250
   55    39   465.000  1.376
   39    40   340.000  1.080
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    48    75.00000  111.63000
   29    33    39    75.00000  112.20000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    48    45    58.35000  112.70000
   33    48    49    58.35000  112.70000
   33    48    51    50.00000  109.50000
   33    39    55    70.00000  124.00000
   33    39    40    35.00000  117.00000
   37    41    42    35.00000  120.00000
   37    41    43    70.00000  124.00000
   41    37    38    35.00000  120.00000
   41    43    44    35.00000  109.50000
   41    43    45    70.00000  112.02700
   41    43    66    75.00000  110.06800
   43    41    42    35.00000  117.00000
   43    45    46    37.50000  110.70000
   43    45    47    37.50000  110.70000
   43    45    48    58.35000  112.70000
   43    66    49    75.00000  113.01200
   43    66    63    75.00000  113.01200
   43    66    67    35.00000  109.50000
   45    43    44    37.50000  110.70000
   45    48    49    58.35000  112.70000
   45    48    51    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    33    37    70.00000  112.02700
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    49    50    37.50000  110.70000
   48    49    52    58.35000  112.70000
   48    49    66    80.00000  111.20000
   48    51    55    90.00000  111.18400
   49    52    53    37.50000  110.70000
   49    52    54    37.50000  110.70000
   49    52    57    58.35000  112.70000
   49    66    63    75.00000  113.01200
   49    66    67    35.00000  109.50000
   52    49    50    37.50000  110.70000
   52    57    58    37.50000  110.70000
   52    57    59    37.50000  110.70000
   52    57    60    58.35000  112.70000
   54    52    53    33.00000  107.80000
   57    52    53    37.50000  110.70000
   57    52    54    37.50000  110.70000
   57    60    61    37.50000  110.70000
   57    60    62    37.50000  110.70000
   57    60    63    58.35000  112.70000
   59    57    58    33.00000  107.80000
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   60    63    64    37.50000  110.70000
   60    63    65    37.50000  110.70000
   60    63    66    80.00000  111.20000
   62    60    61    33.00000  107.80000
   63    60    61    37.50000  110.70000
   63    60    62    37.50000  110.70000
   63    66    67    35.00000  109.50000
   65    63    64    33.00000  107.80000
   66    43    44    35.00000  109.50000
   66    43    45    80.00000  111.20000
   66    49    50    35.00000  109.50000
   66    49    52    80.00000  111.20000
   66    63    64    35.00000  109.50000
   66    63    65    35.00000  109.50000
   51    48    49    50.00000  109.50000
   51    55    56    65.00000  121.00000
   51    55    39    80.00000  120.01400
   55    39    40    40.00000  120.50800
   39    33    37    70.00000  110.12100
   39    33    48    70.00000  112.02700
   39    55    56    65.00000  137.10300
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    48    45   0.44750  1.0 1.0
   29    33    48    45  -0.17800 -1.0 2.0
   29    33    48    45   0.20200  1.0 3.0
   29    33    48    49   0.44750  1.0 1.0
   29    33    48    49  -0.17800 -1.0 2.0
   29    33    48    49   0.20200  1.0 3.0
   29    33    48    51   0.56750  1.0 1.0
   29    33    48    51  -0.07550 -1.0 2.0
   29    33    48    51   0.20000  1.0 3.0
   29    33    39    55   0.42700  1.0 1.0
   29    33    39    55  -0.70350 -1.0 2.0
   29    33    39    55  -0.43150  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    43   7.00000 -1.0 2.0
   33    48    49    50   0.15000  1.0 3.0
   33    48    49    52   0.56750  1.0 1.0
   33    48    49    52  -0.07550 -1.0 2.0
   33    48    49    52   0.20000  1.0 3.0
   33    48    49    66   1.36600  1.0 1.0
   33    48    49    66  -0.11450 -1.0 2.0
   33    48    49    66   0.24250  1.0 3.0
   33    48   -51    55  -0.46850  1.0 1.0
   33    48   -51    55   0.09300 -1.0 2.0
   33    48   -51    55  -0.12850  1.0 3.0
   37    33    48    45   0.34400  1.0 1.0
   37    33    48    45   0.09450 -1.0 2.0
   37    33    48    45   0.11100  1.0 3.0
   37    33    48    49   0.34400  1.0 1.0
   37    33    48    49   0.09450 -1.0 2.0
   37    33    48    49   0.11100  1.0 3.0
   37    33    48    51   0.61850  1.0 1.0
   37    33    48    51  -0.22750 -1.0 2.0
   37    33    48    51   0.15300  1.0 3.0
   37    33    39    55  -0.28300  1.0 1.0
   37    33    39    55   0.26700 -1.0 2.0
   37    33    39    55  -0.63300  1.0 3.0
   37    33    39    40   0.00000  1.0 1.0
   37    41    43    44   0.00000  1.0 1.0
   37    41   -43    45   0.09850  1.0 1.0
   37    41   -43    45   0.15250 -1.0 2.0
   37    41   -43    45  -0.50650  1.0 3.0
   37    41    43    66   0.80850  1.0 1.0
   37    41    43    66  -0.47300 -1.0 2.0
   37    41    43    66  -0.52300  1.0 3.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    43   7.00000 -1.0 2.0
   41    43    45    46   0.15000  1.0 3.0
   41    43    45    47   0.15000  1.0 3.0
   41    43    45    48   0.34400  1.0 1.0
   41    43    45    48   0.09450 -1.0 2.0
   41    43    45    48   0.11100  1.0 3.0
   41    43    66    49   0.08000 -1.0 2.0
   41    43    66    63   0.08000 -1.0 2.0
   41    43    66    67   0.17350  1.0 3.0
   42    41    43    44   0.33100  1.0 3.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    66   0.00000  1.0 1.0
   43    45   -48    33   0.56750  1.0 1.0
   43    45   -48    33  -0.07550 -1.0 2.0
   43    45   -48    33   0.20000  1.0 3.0
   43    45   -48    49   0.56750  1.0 1.0
   43    45   -48    49  -0.07550 -1.0 2.0
   43    45   -48    49   0.20000  1.0 3.0
   43    45    48    51   0.62750  1.0 1.0
   43    45    48    51  -0.30950 -1.0 2.0
   43    45    48    51   0.27300  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    45    48   0.15000  1.0 3.0
   44    43    66    49   0.15000  1.0 3.0
   44    43    66    63   0.15000  1.0 3.0
   44    43    66    67   0.13050  1.0 3.0
   45    43   -66    49   0.47100  1.0 1.0
   45    43    66    63   0.47100  1.0 1.0
   45    43    66    67   0.17350  1.0 3.0
   45    48    49    50   0.15000  1.0 3.0
   45    48    49    52   0.56750  1.0 1.0
   45    48    49    52  -0.07550 -1.0 2.0
   45    48    49    52   0.20000  1.0 3.0
   45    48   -49    66   1.36600  1.0 1.0
   45    48   -49    66  -0.11450 -1.0 2.0
   45    48   -49    66   0.24250  1.0 3.0
   45    48    51    55  -0.46850  1.0 1.0
   45    48    51    55   0.09300 -1.0 2.0
   45    48    51    55  -0.12850  1.0 3.0
   46    45    48    33   0.15000  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    51   0.23400  1.0 3.0
   47    45    48    33   0.15000  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    51   0.23400  1.0 3.0
   48    33    37    38   0.00000  1.0 1.0
   48    33   -37    41   0.09850  1.0 1.0
   48    33   -37    41   0.15250 -1.0 2.0
   48    33   -37    41  -0.50650  1.0 3.0
   48    33   -39    55   0.09850  1.0 1.0
   48    33   -39    55   0.15250 -1.0 2.0
   48    33   -39    55  -0.50650  1.0 3.0
   48    33    39    40   0.00000  1.0 1.0
   48    49    52    53   0.15000  1.0 3.0
   48    49    52    54   0.15000  1.0 3.0
   48    49    52    57   0.56750  1.0 1.0
   48    49    52    57  -0.07550 -1.0 2.0
   48    49    52    57   0.20000  1.0 3.0
   48    49   -66    43   0.47100  1.0 1.0
   48    49    66    63   0.47100  1.0 1.0
   48    49    66    67   0.17350  1.0 3.0
   48    51    55    56   2.00000 -1.0 2.0
   48    51   -55    39  -2.26850  1.0 1.0
   48    51   -55    39   3.39050 -1.0 2.0
   49    48    51    55  -0.46850  1.0 1.0
   49    48    51    55   0.09300 -1.0 2.0
   49    48    51    55  -0.12850  1.0 3.0
   49    52    57    58   0.15000  1.0 3.0
   49    52    57    59   0.15000  1.0 3.0
   49    52    57    60   0.56750  1.0 1.0
   49    52    57    60  -0.07550 -1.0 2.0
   49    52    57    60   0.20000  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   50    49    52    57   0.15000  1.0 3.0
   50    49    66    43   0.15000  1.0 3.0
   50    49    66    63   0.15000  1.0 3.0
   50    49    66    67   0.13050  1.0 3.0
   52    49    66    43   0.47100  1.0 1.0
   52    49    66    63   0.47100  1.0 1.0
   52    49    66    67   0.17350  1.0 3.0
   52    57    60    61   0.15000  1.0 3.0
   52    57    60    62   0.15000  1.0 3.0
   52    57   -60    63   0.56750  1.0 1.0
   52    57   -60    63  -0.07550 -1.0 2.0
   52    57   -60    63   0.20000  1.0 3.0
   53    52    57    58   0.15000  1.0 3.0
   53    52    57    59   0.15000  1.0 3.0
   53    52    57    60   0.15000  1.0 3.0
   54    52    57    58   0.15000  1.0 3.0
   54    52    57    59   0.15000  1.0 3.0
   54    52    57    60   0.15000  1.0 3.0
   57    60    63    64   0.15000  1.0 3.0
   57    60    63    65   0.15000  1.0 3.0
   57    60    63    66   1.36600  1.0 1.0
   57    60    63    66  -0.11450 -1.0 2.0
   57    60    63    66   0.24250  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   58    57    60    62   0.15000  1.0 3.0
   58    57    60    63   0.15000  1.0 3.0
   59    57    60    61   0.15000  1.0 3.0
   59    57    60    62   0.15000  1.0 3.0
   59    57    60    63   0.15000  1.0 3.0
   60    63    66    43   0.47100  1.0 1.0
   60    63   -66    49   0.47100  1.0 1.0
   60    63    66    67   0.17350  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    66   0.19200  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    65   0.15000  1.0 3.0
   62    60    63    66   0.19200  1.0 3.0
   64    63    66    43   0.15000  1.0 3.0
   64    63    66    49   0.15000  1.0 3.0
   64    63    66    67   0.13050  1.0 3.0
   65    63    66    43   0.15000  1.0 3.0
   65    63    66    49   0.15000  1.0 3.0
   65    63    66    67   0.13050  1.0 3.0
   66    43    45    46   0.19200  1.0 3.0
   66    43    45    47   0.19200  1.0 3.0
   66    43   -45    48   1.36600  1.0 1.0
   66    43   -45    48  -0.11450 -1.0 2.0
   66    43   -45    48   0.24250  1.0 3.0
   66    49    52    53   0.19200  1.0 3.0
   66    49    52    54   0.19200  1.0 3.0
   66    49   -52    57   1.36600  1.0 1.0
   66    49   -52    57  -0.11450 -1.0 2.0
   66    49   -52    57   0.24250  1.0 3.0
   51    48    49    50   0.23400  1.0 3.0
   51    48    49    52   0.62750  1.0 1.0
   51    48    49    52  -0.30950 -1.0 2.0
   51    48    49    52   0.27300  1.0 3.0
   51    48    49    66   1.69300  1.0 1.0
   51    48    49    66  -0.48450 -1.0 2.0
   51    55   -39    33   7.00000 -1.0 2.0
   51    55    39    40   7.00000 -1.0 2.0
   56    55    39    33   7.00000 -1.0 2.0
   56    55    39    40   7.00000 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41  -0.28300  1.0 1.0
   39    33    37    41   0.26700 -1.0 2.0
   39    33    37    41  -0.63300  1.0 3.0
   39    33    48    45   0.34400  1.0 1.0
   39    33    48    45   0.09450 -1.0 2.0
   39    33    48    45   0.11100  1.0 3.0
   39    33    48    49   0.34400  1.0 1.0
   39    33    48    49   0.09450 -1.0 2.0
   39    33    48    49   0.11100  1.0 3.0
   39    33   -48    51   0.61850  1.0 1.0
   39    33   -48    51  -0.22750 -1.0 2.0
   39    33   -48    51   0.15300  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   43    42    41    37   1.10000 -1.0 2.0
   51    56    55    39   1.10000 -1.0 2.0
   33    40    39    55   1.10000 -1.0 2.0
END
